SpectraBase Spectrum ID |
EO5F6kVpmve |
Name |
6-(4-(Trifluoromethyl)phenyl)benzo[4,5]thieno[3,2-f]isoquinoline |
Appearance |
White solid |
Carrier Gas |
Helium |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
379.064255053 u |
Formula |
C22H12F3NS |
InChI |
InChI=1S/C22H12F3NS/c23-22(24,25)15-7-5-13(6-8-15)18-11-14-12-26-10-9-16(14)20-17-3-1-2-4-19(17)27-21(18)20/h1-12H |
InChIKey |
SGNUQTGJUJKHEH-UHFFFAOYSA-N |
Instrument Name |
Finnigan MAT 95-XP |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejoc.202101306 |
Molecular Weight |
379.400 g/mol |
Quality |
232 |
Reported Formula |
C22H12F3NS |
SMILES |
C1(=CC=C(C=C1)C(F)(F)F)C=1C2=C(C=3C=CN=CC3C1)C1=C(S2)C=CC=C1 |
SPLASH |
splash10-004i-0009000000-edb5b07e1ada645c45b8 |
Source of Spectrum |
K1-2022-SM31-3r (DOI: 10.1002/ejoc.202101306) |
Thin-Layer Chromatography |
0.32 (Heptane/EtOAc, 1.5:1) |
Wiley ID |
1899050 |